5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide

C9H19NO3 — CID 139993140

IUPAC5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide
SMILESCN(CCCO)C(=O)CCCCO
InChIInChI=1S/C9H19NO3/c1-10(6-4-8-12)9(13)5-2-3-7-11/h11-12H,2-8H2,1H3
InChIKeyMLSWMXLDROUHEX-UHFFFAOYSA-N
MW189.25 g/mol
LogP-0.01
Rot. Bonds7

About 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide

5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide (PubChem CID 139993140) has the molecular formula C9H19NO3 and a molecular weight of 189.25 g/mol. Its IUPAC name is 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide.

Molecular Properties

Compound Name5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide
PubChem CID139993140
Molecular FormulaC9H19NO3
Molecular Weight189.25 g/mol
Exact Mass189.14
IUPAC Name5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide
SMILESCN(CCCO)C(=O)CCCCO
InChIInChI=1S/C9H19NO3/c1-10(6-4-8-12)9(13)5-2-3-7-11/h11-12H,2-8H2,1H3
InChIKeyMLSWMXLDROUHEX-UHFFFAOYSA-N
XLogP-0.01
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-hydroxypropyl)-N-methyldecanamide
CID 59366231
N-(5-hydroxypentyl)-N-methyldodecanamide
CID 107201995
7-amino-N-(5-hydroxypentyl)-N-methylheptanamide
CID 107199281
5-bromo-N-(5-hydroxypentyl)-N-methylpentanamide
CID 107910777
N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide
CID 79191572
4-hydroxy-N-methyl-N-pentylbutanamide
CID 79203931
N-(5-hydroxypentyl)-N-methylbutanamide
CID 107201974
N-(5-hydroxypentyl)-N-methylhept-6-ynamide
CID 107300861
5-hydroxy-N-methyl-N-(2,2,2-trifluoroethyl)pentanamide
CID 79199158
3-bromo-N-(5-hydroxypentyl)-N-methylpropanamide
CID 107198834
5-hydroxy-N-(2-hydroxypropyl)-N-methylpentanamide
CID 79199467
11-hydroxy-N,N-dimethylundecanamide
CID 14819907

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide?
The IUPAC name of 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide (CID 139993140) is 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide.
What is the SMILES notation for 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide?
The canonical SMILES for 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide is CN(CCCO)C(=O)CCCCO.
What is the InChIKey of 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide?
The InChIKey is MLSWMXLDROUHEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3/c1-10(6-4-8-12)9(13)5-2-3-7-11/h11-12H,2-8H2,1H3.
What are the key properties of 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide?
5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide has a molecular weight of 189.25 g/mol, XLogP of -0.01, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide is sourced from PubChem (CID 139993140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).